ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000183
RECORD_TITLE: ANTHRANILIC ACID ISOBUTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ANTHRANILIC ACID ISOBUTYL ESTER
CH$NAME: ORTHO AMINO ISOBUTYLBENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₅NO₂
CH$EXACT_MASS: 193.11028
CH$SMILES: CC(C)COC(=O)c(c1)c(N)ccc1
CH$IUPAC: InChI=1S/C11H15NO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7,12H2,1-2H3
CH$LINK: INCHIKEY ILCLJQFCMRCPNM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8025460

AC$INSTRUMENT: HITACHI RMU-7M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014i-4900000000-25d54d38a0f3ee44d350
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  29 3.78 38
  39 4.91 49
  41 7.63 76
  43 3.25 33
  55 2.72 27
  57 9.21 92
  63 1.66 17
  64 2.42 24
  65 16.24 162
  66 1.89 19
  69 3.7 37
  71 2.42 24
  91 3.7 37
  92 27.57 276
  93 4.76 48
  95 1.06 11
  97 1.51 15
  119 99.99 999
  120 33.08 331
  121 2.87 29
  137 39.65 397
  138 2.95 30
  193 20.62 206
  194 2.27 23
//